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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

37835260
37835260

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Popular Name: ethyl ethyl

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 0.52 1.44 -16.05 1 8 0 96 352.363 7 ↓

Analogs

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Popular Name: 5-(4-acetylpiperazin-1-yl)sulfonyl-3-methyl-1H-pyrazole-4-carboxylic 5-(4-acetylpiperazin-1-yl)sulfon…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -1.10 1.31 -61.59 1 9 -1 127 315.331 3 ↓

Analogs

57478132
57478132
57478145
57478145
57478146
57478146
57931667
57931667
17306764
17306764

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Popular Name: 5-(4-methylsulfonylpiperazin-1-yl)sulfonyl-1H-pyrazole-4-carboxylic 5-(4-methylsulfonylpiperazin-1-y…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -1.31 -1.76 -64.83 1 10 -1 144 337.359 4 ↓

Analogs

57478132
57478132
17306764
17306764
21883902
21883902

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Popular Name: 5-(4-prop-2-ynylpiperazin-1-yl)sulfonyl-1H-pyrazole-4-carboxylic 5-(4-prop-2-ynylpiperazin-1-yl)s…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) -0.53 0.59 -54.67 1 8 -1 109 297.316 4 ↓
Lo Low (pH 4.5-6) -0.53 2.83 -83.88 2 8 0 111 298.324 4 ↓

Parameters Provided:

ring.id = 174756
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 174756 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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